SCHEMBL2115386

SCHEMBL2115386

[O]C1CCN(C2CCC(C3CCC3)C2)CC1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 13/20 0.51
OPRM1 P35372 12/20 0.51
OPRK1 P41145 4/20 0.51
OPRD1 P41143 2/20 0.35
MBTD1 Q05BQ5 1/20 0.33
L3MBTL3 Q96JM7 1/20 0.33
SLC18A3 Q16572 1/20 0.31
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2115761 0.94 OPRM1 (0.47) OPRL1OPRM1OPRK1OPRD1
SCHEMBL2119234 0.87 OPRM1 (0.39) OPRL1OPRM1OPRK1MBTD1L3MBTL3
SCHEMBL2115760 0.82 OPRM1 (0.38) OPRL1OPRM1OPRK1
SCHEMBL2115388 0.82 OPRL1 (0.46) OPRL1OPRM1OPRK1OPRD1MBTD1
SCHEMBL9359371 0.80 OPRM1 (0.51) OPRL1OPRM1OPRK1OPRD1MBTD1
SCHEMBL12856303 0.78 OPRL1 (0.50) OPRL1OPRM1OPRK1OPRD1MBTD1
SCHEMBL27694953 0.78 OPRL1 (0.43) OPRL1OPRM1OPRK1OPRD1MBTD1
SCHEMBL22541115 0.76 OPRM1 (0.44) OPRL1OPRM1OPRK1MBTD1L3MBTL3
SCHEMBL7642489 0.75 OPRL1 (0.55) OPRL1OPRM1OPRK1OPRD1MBTD1
SCHEMBL1814912 0.74 SLC18A3 (0.39) OPRL1OPRM1L3MBTL3SLC18A3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158652-B2 1-Difluoromethyl-5-{4-[3-(1-piperidinyl)propoxy]phenyl}-2(1H)-pyridone; compounds act as histamine-H3 receptor antagonistic substances or inverse-agonistic substances; useful as preventives or remedies for various circular system diseases, nervous system diseases, metabolic system diseases MSD K.K. (JP) 2012-04-17 US disclosed
US-20080269287-A1 Substituted Pyridone Derivative MSD K.K. (JP) 2008-10-30 US disclosed
EP-1820797-A1 SUBSTITUTED PYRIDONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-22 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080269287-A1 Substituted Pyridone Derivative HRH3, HRH4, HRH1 OPRL1 188/4885OPRM1 22/4885OPRK1 69/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.